Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 2/20 | 0.39 |
| ▸ | RAF1 | P04049 | 9/20 | 0.34 |
| ▸ | BRAF | P15056 | 9/20 | 0.34 |
| ▸ | SMG1 | Q96Q15 | 2/20 | 0.33 |
| ▸ | MAPK13 | O15264 | 2/20 | 0.33 |
| ▸ | MTOR | P42345 | 1/20 | 0.33 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.33 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.33 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.33 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.33 |
| ▸ | LRRK2 | Q5S007 | 2/20 | 0.33 |
| ▸ | WDR5 | P61964 | 1/20 | 0.32 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.32 |
| ▸ | TRPV3 | Q8NET8 | 1/20 | 0.32 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL19672014 | 0.84 | PIK3CA (0.43) | PIK3CARAF1BRAFSMG1MAPK13 | |
| SCHEMBL19672018 | 0.83 | PIK3CA (0.43) | PIK3CARAF1BRAFSMG1MAPK13 | |
| SCHEMBL19672037 | 0.82 | PIK3CA (0.43) | PIK3CARAF1BRAFMAPK13LRRK2 | |
| SCHEMBL19672038 | 0.81 | LRRK2 (0.40) | PIK3CARAF1BRAFMAPK13MAPK9 | |
| SCHEMBL19671942 | 0.80 | PIK3CA (0.40) | PIK3CARAF1BRAFSMG1MAPK13 | |
| SCHEMBL19672084 | 0.80 | PIK3CA (0.40) | PIK3CARAF1BRAFSMG1MAPK13 | |
| SCHEMBL19671946 | 0.79 | PIK3CA (0.39) | PIK3CARAF1BRAFSMG1MAPK13 | |
| SCHEMBL19671940 | 0.78 | PIK3CA (0.47) | PIK3CARAF1BRAFSMG1MAPK13 | |
| SCHEMBL21416669 | 0.76 | PIK3CA (0.44) | PIK3CARAF1BRAFSMG1MAPK13 | |
| SCHEMBL19672200 | 0.75 | LRRK2 (0.44) | PIK3CARAF1BRAFMAPK13MAPK14 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2964221-B1 | COMPOUNDS INHIBITING LEUCINE-RICH REPEAT KINASE ENZYME ACTIVITY | MERCK SHARP & DOHME (US) | 2017-12-06 | — | — | EP | disclosed |